Estradiol 3-tetrahydropyranyl ether
TL;DR: Estradiol 3-tetrahydropyranyl ether (CAS 54100-53-7) is a chemical compound with molecular formula C23H32O3 and molecular weight 356.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8R,9S,13S,14S,17S)-13-methyl-3-(oxan-2-yloxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
Also Known As: Estradiol 3-tetrahydropyranyl ether, Estradiol-3-tetrahydropyranylether, (17, A)-3-(tetrahydro-2h-pyran-2-yloxy)estra-1,3,5(10)-trien-17-ol, 17.beta.-Estradiol, 3-(tetrahydropyran-2-yl ether)
| Molecular Formula | C23H32O3 |
|---|---|
| Molecular Weight | 356.24 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.23514 |
| Heavy Atoms | 26 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 54100-53-7 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)OC5CCCCO5 |
| InChIKey | BOLMNLJKDBCJIB-CUFSGNDSSA-N |
Product Overview
Estradiol 3-tetrahydropyranyl ether (CAS 54100-53-7), with molecular formula C23H32O3 and molecular weight 356.24 g/mol. IUPAC: (8R,9S,13S,14S,17S)-13-methyl-3-(oxan-2-yloxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol.
Chemical Property Profile of Estradiol 3-tetrahydropyranyl ether
Property Insights of Estradiol 3-tetrahydropyranyl ether
The XLogP value of 3.9 indicates that Estradiol 3-tetrahydropyranyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, Estradiol 3-tetrahydropyranyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Estradiol 3-tetrahydropyranyl ether has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Estradiol 3-tetrahydropyranyl ether?
The CAS number of Estradiol 3-tetrahydropyranyl ether is 54100-53-7.
What is the molecular formula of Estradiol 3-tetrahydropyranyl ether?
The molecular formula of Estradiol 3-tetrahydropyranyl ether is C23H32O3.
What is the molecular weight of Estradiol 3-tetrahydropyranyl ether?
The molecular weight of Estradiol 3-tetrahydropyranyl ether is 356.24 g/mol.
Where can I buy Estradiol 3-tetrahydropyranyl ether?
You can request a quote for Estradiol 3-tetrahydropyranyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estradiol 3-tetrahydropyranyl ether?
Yes, KEHONG BIO provides custom synthesis services for Estradiol 3-tetrahydropyranyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.